5-tert-butyl-2-methyl-4-nitro-N-(2-oxidanylpropyl)-N-(phenylmethyl)pyrazole-3-carboxamide

Systemtic Name: 5-tert-butyl-2-methyl-4-nitro-N-(2-oxidanylpropyl)-N-(phenylmethyl)pyrazole-3-carboxamide Openeye Name: N-benzyl-5-tert-butyl-N-(2-hydroxypropyl)-2-methyl-4-nitro-pyrazole-3-carboxamide CAS Name: 5-tert-butyl-N-(2-hydroxypropyl)-2-methyl-4-nitro-N-(phenylmethyl)-3-pyrazolecarboxamide IUPAC Name: N-benzyl-5-tert-butyl-N-(2-hydroxypropyl)-2-methyl-4-nitropyrazole-3-carboxamide Traditional Name: N-benzyl-5-tert-butyl-N-(2-hydroxypropyl)-2-methyl-4-nitro-pyrazole-3-carboxamide Formula: C19H26N4O4 MolecularWeight: 374.43414

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(CC1=CC=CC=C1)C(=O)C2=C(C(=NN2C)C(C)(C)C)[N+](=O)[O-])O

Isomeric SMILES

CC(CN(CC1=CC=CC=C1)C(=O)C2=C(C(=NN2C)C(C)(C)C)[N+](=O)[O-])O

InChI

InChI=1S/C19H26N4O4/c1-13(24)11-22(12-14-9-7-6-8-10-14)18(25)16-15(23(26)27)17(19(2,3)4)20-21(16)5/h6-10,13,24H,11-12H2,1-5H3